4-(4-iodo-1H-pyrazol-1-yl)piperidine - 97%, high purity , CAS No.1229457-94-6

Name: 4-(4-iodo-1H-pyrazol-1-yl)piperidine - 97%, high purity , CAS No.1229457-94-6
Price: 72.9 USD
Availability: InStock

Grade & Purity:

In stock

Item Number

P627591

Grouped product items
SKU	Size	Availability	Price
P627591-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$72.90
P627591-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$116.90
P627591-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$193.90
P627591-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$290.90
P627591-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,456.90

Synonyms	4-(4-Iod-1H-pyrazol-1-yl)-piperidine \| 1229457-94-6 \| DTXSID50893742 \| EN300-118521 \| AMY5048 \| F2167-2824 \| W11562 \| 4-(4-Iodo-1H-pyrazol-1-yl)piperidine \| CS-0038566 \| BS-41723 \| AKOS013751441 \| EC 639-824-6 \| 4-(4-Iodo-1-pyrazolyl)piperidine \| 4-(4-iod
Specifications & Purity	≥97%
Shipped In	Normal

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Piperidines
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Piperidines
Alternative Parents	Aryl iodides Pyrazoles Heteroaromatic compounds Dialkylamines Azacyclic compounds Organopnictogen compounds Organoiodides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Aryl halide - Aryl iodide - Piperidine - Azole - Heteroaromatic compound - Pyrazole - Secondary aliphatic amine - Azacycle - Secondary amine - Organoiodide - Organohalogen compound - Amine - Hydrocarbon derivative - Organopnictogen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as piperidines. These are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five carbon atoms.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

IUPAC Name	4-(4-iodopyrazol-1-yl)piperidine
INCHI	InChI=1S/C8H12IN3/c9-7-5-11-12(6-7)8-1-3-10-4-2-8/h5-6,8,10H,1-4H2
InChIKey	GYYVRUODGBPRHC-UHFFFAOYSA-N
Smiles	C1CNCCC1N2C=C(C=N2)I
Isomeric SMILES	C1CNCCC1N2C=C(C=N2)I
Alternate CAS	1229457-94-6
PubChem CID	53256681
Molecular Weight	277.11

Molecular Weight	277.110 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	277.008 Da
Monoisotopic Mass	277.008 Da
Topological Polar Surface Area	29.900 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	147.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Basic Description